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(E)-1-(2,4-Dinitrophenyl)-2-pentylidenehydrazine
The title compound, C(11)H(14)N(4)O(4), is essentially planar with an r.m.s. deviation for the 19 non-H atoms of 0.152 Å. The conformation about the C=N bond is E, and the molecule has a U-shape as the butyl group folds over towards the aromatic system. An intramolecular C—H⋯N interaction occurs....
Autores principales: | , , , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2010
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979683/ https://www.ncbi.nlm.nih.gov/pubmed/21579891 http://dx.doi.org/10.1107/S1600536810002102 |
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author | Neunfeldt, Patrícia D. Duval, Auri R. Cunico, Wilson Wardell, Solange M. S. V. Tiekink, Edward R. T. Wardell, James L. |
author_facet | Neunfeldt, Patrícia D. Duval, Auri R. Cunico, Wilson Wardell, Solange M. S. V. Tiekink, Edward R. T. Wardell, James L. |
author_sort | Neunfeldt, Patrícia D. |
collection | PubMed |
description | The title compound, C(11)H(14)N(4)O(4), is essentially planar with an r.m.s. deviation for the 19 non-H atoms of 0.152 Å. The conformation about the C=N bond is E, and the molecule has a U-shape as the butyl group folds over towards the aromatic system. An intramolecular C—H⋯N interaction occurs. The crystal packing is dominated by N—H⋯O hydrogen bonding and C—H⋯O contacts, leading to twisted zigzag supramolecular chains along the c direction. The crystal packing brings two nitro O atoms into an unusually close proximity of 2.686 (4) Å. While the nature of this interaction is not obvious, there are several precendents for such short nitro–nitro O⋯O contacts of less than 2.70 Å in the crystallographic literature. |
format | Text |
id | pubmed-2979683 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2010 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29796832010-12-30 (E)-1-(2,4-Dinitrophenyl)-2-pentylidenehydrazine Neunfeldt, Patrícia D. Duval, Auri R. Cunico, Wilson Wardell, Solange M. S. V. Tiekink, Edward R. T. Wardell, James L. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(11)H(14)N(4)O(4), is essentially planar with an r.m.s. deviation for the 19 non-H atoms of 0.152 Å. The conformation about the C=N bond is E, and the molecule has a U-shape as the butyl group folds over towards the aromatic system. An intramolecular C—H⋯N interaction occurs. The crystal packing is dominated by N—H⋯O hydrogen bonding and C—H⋯O contacts, leading to twisted zigzag supramolecular chains along the c direction. The crystal packing brings two nitro O atoms into an unusually close proximity of 2.686 (4) Å. While the nature of this interaction is not obvious, there are several precendents for such short nitro–nitro O⋯O contacts of less than 2.70 Å in the crystallographic literature. International Union of Crystallography 2010-01-30 /pmc/articles/PMC2979683/ /pubmed/21579891 http://dx.doi.org/10.1107/S1600536810002102 Text en © Neunfeldt et al. 2010 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited. |
spellingShingle | Organic Papers Neunfeldt, Patrícia D. Duval, Auri R. Cunico, Wilson Wardell, Solange M. S. V. Tiekink, Edward R. T. Wardell, James L. (E)-1-(2,4-Dinitrophenyl)-2-pentylidenehydrazine |
title | (E)-1-(2,4-Dinitrophenyl)-2-pentylidenehydrazine |
title_full | (E)-1-(2,4-Dinitrophenyl)-2-pentylidenehydrazine |
title_fullStr | (E)-1-(2,4-Dinitrophenyl)-2-pentylidenehydrazine |
title_full_unstemmed | (E)-1-(2,4-Dinitrophenyl)-2-pentylidenehydrazine |
title_short | (E)-1-(2,4-Dinitrophenyl)-2-pentylidenehydrazine |
title_sort | (e)-1-(2,4-dinitrophenyl)-2-pentylidenehydrazine |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979683/ https://www.ncbi.nlm.nih.gov/pubmed/21579891 http://dx.doi.org/10.1107/S1600536810002102 |
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